交互四元体系Na+,K+∥Br-,SO42--H2O 323K相平衡理论计算Theoretical calculations of phase equilibrium in interactive quaternary system Na+,K+∥Br-,SO42--H2O at 323K
曾晓晓,桑世华,王丹,张俊杰
摘要(Abstract):
应用323 K三元子体系的溶解度数据,采用多元线性回归方法拟合出该四元体系在323 K时的Pitzer方程的混合离子相互作用参数θ(Br-,SO24-),Ψ(Na+,Br-,SO24-),Ψ(K+,Br-,SO24-)(相关文献鲜有报道),在此基础上应用Pitzer方程对323 K四元体系Na+,K+∥Br-,SO24--H2O的溶解度数据进行理论计算,并用计算出的溶解度数据绘制出四元相图。计算结果表明,模拟计算值与实测值基本吻合,较好地验证了实验数据的准确性,同时也表明含有合理参数的Pitzer模型完全可以描述含Na+,K+∥Br-,SO24--H2O的体系。
关键词(KeyWords): 水盐体系;Pitzer理论;溶解度;Pitzer参数
基金项目(Foundation): 国家自然科学基金资助项目(40973047);; 教育部新世纪优秀人才资助计划项目(NCET-07-0125);; 四川省杰出青年学科带头人培养资助计划项目(08ZQ026-017)
作者(Author): 曾晓晓,桑世华,王丹,张俊杰
参考文献(References):
- [1]桑世华,孙明亮,李恒,等.Na+,K+∥Br-,SO24--H2O交互四元体系323K时相平衡研究[J].无机化学学报,2011,27(5):845-849.
- [2]PITZER K S,MAGORGA G.Thermodynamics of electro-lytes.Ⅱ.Activity and osmotic coefficients for strongelectrolytes with one or both ions univalent[J].J PhysChem,1973,77(19):2300-2308.
- [3]PITZER K S,MAGORGA G.Thermodynamics of electro-lytes.Ⅲ.Activity and osmotic coefficients for 2-2 elec-trolytes[J].J Solu Chem,1974,3(7):539-546.
- [4]PITZER K S,KIM J J.Thermodynamics of electrolytes.Ⅳ.Activity and osmotic coefficients for mixed electro-lytes[J].J Amer Chem Soc,1974,96(18):5701-5706.
- [5]HARVIE C E,WEARE J H.Mineral equilibria in a six-component seawater system Na-K-Mg-Ca-SO4-Cl-H2O at25℃[J].Geochim Cosmochim Acta,1980,44(9):1335-1347.
- [6]HARVIE C E,EUGSTER H P,WEARE J H.Mineralequilibria in the six-component seawater system Na-K-Mg-Ca-SO4-Cl-H2O at 25℃.Ⅱ:Composition of the saturatedsolutions[J].Geochim Cosmochim Acta,1982,46(9):1603-1618.
- [7]SPENCER R J,MOLLER N,WEARE J H.The predic-tion of mineral solubilities in natural waters:a chemicalequilibrium model for the Na-K-Ca-Mg-Cl-SO4-H2O sys-tem at temperatures below 25℃[J].Geochim Cos-machim Acta,1990,54(3):575-590.
- [8]CHRISTOMIR C,MOLLER N.A chemical equilibriummodel of solution behavior and solubility in the H-Na-K-Ca-OH-Cl-HSO4-SO4-H2O system to high concentrationand temperature[J].Geochimica et Cosmochimica Acta,2004,68(18):3717-3739.
- [9]CHRISTOMIR C,MOLLER N.Chemical equilibriummodel of solution behavior and solubility in the H-Na-K-OH-Cl-HSO4-SO4-H2O system to high concentration andtemperature[J].Geochimica et Cosmochimica Acta,2004,68(6):1309-1331.
- [10]CHRISTOMIR C.An isopiestic study of aqueous NaBrand KBr at 50℃:chemical equilibrium model of solutionbehavior and solubility in the NaBr-H2O,KBr-H2O andNa-K-Br-H2O systems to high concentration and tempera-ture[J].Geochimica et Cosmochimica Acta,2007,71(14):3557-3569.
- [11]HARVIE C E,MOLLER N,WEARE J H.The predic-tion of mineral solubilities in natural waters:the Na-K-Mg-Ca-H-Cl-SO4-OH-HCO3-CO3-CO2-H2O system tohigh ionic strengths at 25℃[J].Geochimica et Cosmo-chimica Acta,1984,48(4):723-751.
- [12]MOLLER N.The prediction of mineral solubilities in natu-ral waters:a chemical equilibrium model for the Na-Ca-Cl-SO4-H2O system,to high temperature and concentration[J].Geochimi Cosmochim Acta,1988,52(4):821-837.
- [13]黄雪莉,宋彭生.Na+,K+,Mg2+∥NO3-,Cl-,SO24--H2O体系25℃热力学模型和溶解度预测.Ⅰ:六元体系所需的Pitzer参数[J].盐湖研究,2005,13(4):21-28.
- [14]宋彭生,黄雪莉.Na+,K+,Mg2+∥NO3-,Cl-,SO24--H2O体系25℃热力学模型和溶解度预测.Ⅱ:四元体系Na+,K+/NO3-,Cl--H2O的Pitzer混合参数及其应用[J].盐湖研究,2007,15(1):29-33.
- [15]张健,黄雪莉,宋彭生.Na+,K+,Mg2+∥NO3-,Cl-,SO24--H2O体系25℃热力学模型和溶解度预测.Ⅲ:四元体系K+,Mg2+∥NO3-,SO24--H2O的Pitzer混合参数及其应用[J].盐湖研究,2008,16(1):17-21.
- [16]宋彭生,黄雪莉.Na+,K+,Mg2+∥NO3-,Cl-,SO24--H2O体系25℃热力学模型和溶解度预测.Ⅳ:四元体系K+,Mg2+∥NO3-,Cl--H2O的Pitzer混合参数及其应用[J].盐湖研究,2008,16(2):22-25.
- [17]孙明亮,桑世华,李恒,等.NaBr-Na2SO4-H2O三元体系323K相平衡研究[J].化学工程,2010,38(7):67-70.
- [18]ПеЛЬШаАД.多组分实验体系水盐体系实验数据手册[M].2版.列宁格勒:化学出版社,1973:323-325.